4-[(2-chloranyl-5-methyl-phenoxy)methyl]-N-(4-methyl-3,5-dinitro-phenyl)thiophene-2-carboxamide

Systemtic Name: 4-[(2-chloranyl-5-methyl-phenoxy)methyl]-N-(4-methyl-3,5-dinitro-phenyl)thiophene-2-carboxamide Openeye Name: 4-[(2-chloro-5-methyl-phenoxy)methyl]-N-(4-methyl-3,5-dinitro-phenyl)thiophene-2-carboxamide CAS Name: 4-[(2-chloro-5-methylphenoxy)methyl]-N-(4-methyl-3,5-dinitrophenyl)-2-thiophenecarboxamide IUPAC Name: 4-[(2-chloro-5-methylphenoxy)methyl]-N-(4-methyl-3,5-dinitrophenyl)thiophene-2-carboxamide Traditional Name: 4-[(2-chloro-5-methyl-phenoxy)methyl]-N-(4-methyl-3,5-dinitro-phenyl)thiophene-2-carboxamide Formula: C20H16ClN3O6S MolecularWeight: 461.87554

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)Cl)OCC2=CSC(=C2)C(=O)NC3=CC(=C(C(=C3)[N+](=O)[O-])C)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1)Cl)OCC2=CSC(=C2)C(=O)NC3=CC(=C(C(=C3)[N+](=O)[O-])C)[N+](=O)[O-]

InChI

InChI=1S/C20H16ClN3O6S/c1-11-3-4-15(21)18(5-11)30-9-13-6-19(31-10-13)20(25)22-14-7-16(23(26)27)12(2)17(8-14)24(28)29/h3-8,10H,9H2,1-2H3,(H,22,25)